Journal of Computational Chemistry

2.7(top 20%)

impact factor

8.5K(top 2%)

papers

703.7K(top 1%)

citations

257(top 1%)

h-index

2.7(top 20%)

extended IF

10.0K

all documents

745.4K

doc citations

749(top 0.1%)

g-index

Top Authors (by article citations)

#	Author	Articles	Citations	R ARank	R CRank
1	Wonpil Im	2	5,408	1	1
1	Sunhwan Jo	1	5,402	1	1
1	Taehoon Kim	1	5,402	1	1
4	Karol M Langner	1	4,766	1	1
4	Noel M O'boyle	1	4,766	2	1
6	Robert J Woods	1	1,778	2	1
6	Karl N Kirschner	1	1,778	2	1
6	B Lachele Foley	1	1,778	1	1
6	Jorge Gonzalez-Outeirino	1	1,778	1	1
10	Florian Weigend	1	552	2	1
11	Olgun Guvench	1	483	1	1
11	Alexander D Mackerell	1	483	5	2
11	Richard W Pastor	1	483	2	2
11	John W Brady	1	483	1	1
11	Alexander D Mackerell Jr	1	483	1	1
17	Michael F Crowley	1	360	1	1
17	David A Case	1	360	5	2
19	Ke-Li Han	2	317	4	3
19	Guangjiu Zhao	1	307	1	3
21	Joachim Sauer	1	294	2	1
21	Marek Sierka	1	294	1	1
23	Ferran Feixas	1	261	2	1
23	Eduard Matito	1	261	1	1
23	Jordi Poater	1	261	1	1
23	Miquel Solà	2	295	2	1
27	Lorenzo Maschio	2	469	1	1
27	Michel Rérat	1	253	3	2
27	Roberto Dovesi	2	337	2	2
27	Mauro Ferrero	1	253	2	2
31	Denis Usvyat	1	216	1	1
31	Martin Schütz	1	216	3	1
31	Silvia Casassa	1	216	1	1
34	Pál Jedlovszky	1	181	3	1
34	Lívia B Pártay	1	181	1	1
34	Gyorgy Hantal	1	181	1	1
34	Árpád Vincze	1	181	1	1
38	Ke Chen	1	148	1	1
38	Lukasz A Kurgan	1	148	2	4
38	Wilfred F Van Gunsteren	1	148	2	2
38	Markus Christen	1	148	1	1
42	Seung Kyu Min	1	144	1	1
42	Kwang S Kim	2	232	3	2
42	Dongwook Kim	1	144	1	1
45	Hongjun Xiang	1	138	2	2
45	Myung-Hwan Whangbo	1	138	2	2
45	Christoph R Jacob	1	138	2	2
45	Lucas Visscher	1	138	3	4
45	Johannes Neugebauer	2	159	1	1
50	Marcel Swart	1	135	1	2
50	Friedrich Matthias Bickelhaupt	2	179	1	2
52	Ryangguk Kim	1	120	1	1
53	Bruce R Donald	1	117	1	2
53	Ivelin Georgiev	1	117	1	1
55	Shan Zhao	1	112	1	1
56	Stefano Corni	1	109	1	1
57	C Richard A Catlow	1	105	4	4
57	Alexey A Sokol	1	105	2	2
57	Scott M Woodley	1	105	1	3
61	Edward J Maginn	1	102	2	4
61	Wei Shi	1	102	2	2
63	Yongcheng Zhou	1	98	1	1
63	Michael Feig	3	208	1	1
65	Michael K Gilson	1	97	1	2
66	Francisco Javier Prado-Prado	1	90	1	2
66	Humbert González-Díaz	2	138	2	4
66	Kuo-Chen Chou	2	166	1	5
69	David Avnir	1	89	2	2
69	Pere Alemany	3	173	1	1
69	David Casanova	2	144	1	2
69	Mark Pinsky	2	144	1	1
73	Woo Youn Kim	1	88	1	2
74	Claudio M Zicovich-Wilson	1	84	2	3
74	Fabien Pascale	1	84	1	1
74	F Javier Torres	1	84	2	2
74	Coen de Graaf	1	84	2	1
74	Núria Queralt-Rosinach	1	84	1	1
74	Celestino Angeli	1	84	2	2
74	Rosa Caballol	1	84	1	1
74	Ian Gould	2	110	1	1
74	Renzo Cimiraglia	1	84	2	1
83	Sofie Van Damme	1	80	1	1
83	Stijn Fias	1	80	1	2
83	Patrick Bultinck	1	80	4	3
86	Jörg Langowski	1	77	1	2
86	Joanna Trylska	2	84	1	2
86	Jeremy C Smith	1	77	4	5
86	Valentina Tozzini	1	77	1	1
90	Weihua Zhu	1	74	1	1
91	Tatsuhiko Miyata	1	73	1	1
91	Sandeep Patel	1	73	2	3
91	Fumio Hirata	1	73	1	1
94	Jaroslav V Burda	1	69	1	1
94	Zdeněk Chval	1	69	1	1
94	Miroslav Sip	1	69	1	1
97	Richard Dronskowski	3	80	1	1
98	György Lendvay	1	67	3	2
98	Robert Ponec	1	67	1	1
100	Elzbieta Guziewicz	1	65	3	5
100	Tomasz D Durakiewicz	1	65	1	1
100	John Joyce	1	65	1	1
100	Gustavo E Scuseria	1	65	5	6
100	Juan E Peralta	1	65	1	2
100	Tomasz Durakiewicz	1	65	1	1
106	Pavel Hobza	1	64	7	9
106	Michal Pitoňák	1	64	1	5
106	Ivo Stary	1	64	1	3
106	Thomas S Hofer	1	64	3	1
106	Lubomír Rulíšek	1	64	2	3
106	Bernd M Rode	1	64	4	1
112	Alexei M Nikitin	1	63	1	1
112	Alexander P Lyubartsev	1	63	1	2
114	Yan Zhao	1	61	3	8
114	Donald G Truhlar	1	61	8	10
116	Jean-Philip Piquemal	1	60	2	2
116	Manuel Richter	1	60	2	2
116	Julien Pilmé	1	60	1	1
116	Daniel Fritsch	1	60	2	1
121	Vicenzo Barone	1	59	6	8
121	Yaakov Levy	1	59	1	2
121	Roberto Improta	1	59	1	5
121	Fabrizio Santoro	1	59	2	5
126	Santiago Alvarez	1	55	4	6
127	Sharon Ashbrook	1	52	1	2
127	Eric Furet	1	52	1	2
127	Jérôme Cuny	1	52	1	1
127	Regis Gautier	1	52	1	1
127	Chris J Pickard	1	52	5	6
127	Sabri Messaoudi	1	52	1	1
127	Sharon E Ashbrook	1	52	1	2
134	Dmitri G Fedorov	1	51	2	2
135	Chan Kyung Kim	3	77	1	2
135	Fernanda Borges	2	99	1	2
135	Maria Natália Dias Soeiro Cordeiro	2	99	2	2
135	Maykel Cruz-Monteagudo	2	99	1	1
140	Francisco Rodríguez-Ropero	2	53	1	1
140	Jordi Casanovas	1	49	4	3
140	Gilles Frison	1	49	1	2
140	Gilles Ohanessian	1	49	3	3
140	Carlos Aleman	2	53	4	6
145	D Peter Tieleman	1	48	3	7
145	Lourdes Santana	1	48	1	3
145	Eugenio Eu Uriarte	1	48	2	3
145	Giorgio Colombo	1	48	2	3
145	Luca Monticelli	1	48	1	4
145	Mikael P Johansson	1	48	1	3
145	Santiago Vilar Varela	1	48	1	2
145	Ville R I Kaila	1	48	1	2
154	Markus Meuwly	1	47	2	3
154	Maurizio Recanatini	2	82	1	3
154	Matteo Masetti	1	47	1	2
154	Andrea Cavalli	2	82	2	4
158	Shuyan Li	1	46	1	1
158	Paola Gramatica	1	46	2	3
158	Xiao-Jun Yao	1	46	2	1
158	Jia-Zhong Li	1	46	2	1
162	Kin-Yiu Wong	1	45	1	1
162	Jeffrey Skolnick	1	45	1	4
162	Michal Brylinski	1	45	1	3
162	Dan Thomas Major	1	45	1	2
162	Jiali Gao	1	45	2	3
167	Célia Fonseca Guerra	1	44	1	3
167	Francesca Spyrakis	1	44	2	2
167	Saverio Alberti	1	44	1	2
167	Pietro Cozzini	1	44	2	2
167	Glen E Kellogg	1	44	3	3
167	Angelo Facchiano	1	44	2	2
167	Anna Marabotti	1	44	4	2
167	Andrea Mozzarelli	1	44	3	4
175	Michel Masella	1	42	1	1
175	Daniel Borgis	1	42	1	1
177	Holger Kleinke	1	41	1	1
178	Robert A Evarestov	1	40	2	1
178	Dmitry Bocharov	1	40	1	1
178	Mark A Olson	1	40	1	1
178	Eugene A Kotomin	1	40	3	4
178	Charles L Brooks	1	40	2	5
178	Andrei V Bandura	1	40	1	3
178	Charles L Brooks Iii	1	40	1	2
185	Hendrik Zipse	1	39	1	2
185	G Narahari Sastry	1	39	2	7
185	Prévost Chantal	1	39	1	1
188	Emilia Sicilia	1	38	2	2
188	Juan Torras	1	38	2	2
188	S B Trickey	1	38	1	1
188	Kim A Sharp	1	38	1	2
188	Qian-Zhong Li	1	38	1	2
188	Gustavo M. Seabra	1	38	1	1
188	Gennady Chuev	1	38	2	1
188	Xiuzhen Hu	1	38	1	1
188	Russo Nino	2	67	3	4
188	Maxim V Fedorov	1	38	1	3
198	Svilen Bobev	1	37	3	3
198	Natercia Bras	1	37	1	2
198	Sheng-Qing Xia	1	37	2	2
198	Maria J. Ramos	1	37	5	7
198	Pedro Alexandrino Fernandes	1	37	4	6
198	Sviatoslav Baranets	1	37	2	3
198	Pedro A Fernandes	1	37	3	4
205	Hiromi Nakai	3	71	1	2
205	Gromiha Michael	1	36	2	4
205	Yutaka Imamura	2	50	1	1
205	M Michael Gromiha	1	36	2	2
205	Liang-Tsung Huang	1	36	1	1
210	Xueguang Shao	1	35	2	4
210	Wolfgang B Fischer	1	35	1	2
210	Ronald M Levy	1	35	1	1
210	Marco De Amici	1	35	1	2
210	Emilio Gallicchio	1	35	1	2
210	Jens Krüger	1	35	1	1
210	Giovanni Grazioso	1	35	1	1
210	Carlo De Micheli	1	35	1	2
210	Xiaoli Yang	1	35	1	1
219	Ursula Röthlisberger	1	34	2	4
219	Alessandra Magistrato	1	34	2	3
219	Bernd Doser	1	34	1	3
219	Christian Ochsenfeld	1	34	2	3
219	Max W Chang	1	34	1	1
219	Jörg Kussmann	1	34	1	1
219	David Goodsell	1	34	1	2
219	Jan Reedijk	1	34	12	16
219	Kate S Carroll	1	34	1	3
219	Paolo Ruggerone	1	34	2	5
219	Pedro Salvador Sedano	1	34	1	2
219	Miquel Torrent-Sucarrat	1	34	1	3
219	Richard K Belew	1	34	1	1
234	Asit Kumar Chandra	1	33	1	1
234	Ernst-Walter Knapp	1	33	1	4
238	Gisbert Schneider	1	32	2	8
238	Rong-Zhen Liao	1	32	1	2
238	Mahmoud Mirzaei	1	32	2	3
238	Matthias S Rupp	1	32	1	1
238	Ewgenij Proschak	1	32	1	2
238	Bernd Engels	2	51	1	4
238	Nasser L Hadipour	1	32	2	4
247	Martin J Field	1	30	1	3
247	Ignacio Fdez Galván	1	30	2	3
247	Sándor Lovas	4	52	1	1
247	Jozsef Csontos	3	42	1	1
251	Neetha Mohan	1	29	1	1
251	Cherumuttathu H Suresh	2	48	1	4
251	Miquel Llunell	1	29	1	2
251	Vladimir A Palyulin	1	29	3	1
251	Carlo Adamo	1	29	6	8
251	Denis Jacquemin	1	29	5	7
251	Enric Canadell	1	29	3	4
251	Ilaria Ciofini	1	29	3	6
251	Volodymyr G. Bdzhola	1	29	1	2
260	Atsushi Togo	1	28	2	3
260	Peter Kroll	1	28	3	4
262	Feliu Maseras	1	27	2	8
262	Steven J Stuart	1	27	1	2
262	Thomas Simonson	1	27	2	4
265	Li Wang	1	26	1	1
265	Antony D Gee	1	26	2	2
265	Francisco Torrens	1	26	3	6
265	Juan A Castillo-Garit	1	26	1	3
265	Ramon Garcia-Domenech	2	45	1	4
265	Yovani Marrero-Ponce	2	45	1	5
271	Richard J Wheatley	1	25	1	3
271	Stefano de Gironcoli	1	25	3	4
271	Pankaj R Daga	1	25	1	1
271	Robert J Doerksen	1	25	1	1
271	Dario Alfè	1	25	3	6
276	Dimitris K Agrafiotis	1	24	1	1
276	Deepak Bandyopadhyay	1	24	1	1
278	Petr Bouř	1	23	1	3
278	Wataru Shinoda	1	23	2	5
278	Afshan Mohajeri	1	23	2	5
278	Valery V Andrushchenko	1	23	1	2
278	Bahram Hemmateenejad	1	23	7	7
283	Alfonso Jaramillo	1	22	1	3
283	Javier Carrera	1	22	1	3
285	Edward F Valeev	1	21	3	3
285	Ying Xue	2	27	2	4
285	Ayako Nakata	1	21	1	1
285	Ye Mei	1	21	1	3
285	Masato Kobayashi	1	21	1	2
285	Takashi Tsuchimochi	1	21	1	1
285	Yong Wu	2	27	1	1
285	Yong Wu	2	27	1	1
285	Carmen Herrmann	1	21	1	4
285	Markus Reiher	1	21	5	11
285	Joseph P Kenny	1	21	1	1
296	Pedro Noheda	1	19	1	1
296	Jose Manuel Garcia De La Vega	1	19	1	2
296	Luis A Montero	1	19	3	3
296	Rachel Crespo-Otero	1	19	3	3
300	Nihar R Jena	1	18	1	1
301	Wei Ji	1	17	1	4
301	Gilberto Teobaldi	1	17	1	3
301	Russell J Boyd	1	17	1	3
301	Tanja van Mourik	1	17	1	2
301	Xavier Barril	1	17	1	4
301	Krisztian Palotas	1	17	1	2
301	Linda A Zotti	1	17	1	2
301	F Javier Luque	1	17	4	12
301	Modesto Orozco López	1	17	2	11
301	Darrin M York	1	17	3	6
301	Ana Maria Velasco	1	17	2	2
301	Timothy J Giese	1	17	2	2
313	Gordon J Miller	1	16	2	3
313	Elena R Alonso	1	16	1	3
313	Yi Luo	2	24	3	8
313	Jan M L Martin	1	16	2	5
313	Udo Schnupf	1	16	2	2
313	Małgorzata Kotulska	1	16	1	1
313	Witold Dyrka	1	16	1	1
313	Jun Jiang	1	16	1	2
313	Ilana Bar	1	16	2	3
313	Yi Luo	1	16	3	6
313	Bin Gao	1	16	2	3
326	Leticia Gonzalez	1	15	4	6
326	Seung-Yeon Kim	1	15	1	2
326	Ines Corral	1	15	1	5
329	Birgit Schiøtt	1	14	3	4
329	Yuan-Ping Yi	1	14	1	3
329	Chin-Hung Lai	1	14	2	4
329	Chang-Guo Zhan	1	14	4	10
329	Nitin S Sapre	1	14	1	1
329	Robert M Whitnell	1	14	1	1
329	Qingxu Li	1	14	1	3
329	Zhigang Shuai	1	14	3	11
329	Dow P Hurst	1	14	1	2
338	Karin Fink	1	13	1	2
338	Milan Ončák	1	13	2	5
338	Wolfhard Janke	1	13	4	5
338	Michael P Bachmann	1	13	2	4
338	Shridhar R Gadre	1	13	4	5
338	Alexander Larin	2	18	1	2
344	Henry P Pinto	1	12	1	2
344	Dong-Kyun Seo	1	12	1	3
344	Brian F Yates	1	12	2	7
344	Hujun Xie	1	12	1	3
344	Takao Tsuneda	1	12	1	3
344	Ruibo Wu	2	17	1	3
344	Paweł Szabelski	1	12	1	2
344	Miroslav Kohout	2	19	1	5
344	Matthew A Addicoat	1	12	1	2
344	Andrei L Tchougréeff	1	12	1	1
344	Alexey I Baranov	1	12	2	3
344	Kimihiko Hirao	1	12	3	5
344	Mark A Buntine	1	12	1	3
344	Zexing Cao	2	17	1	4
344	Gregory F Metha	1	12	1	4
344	Fahrettin Goktas	1	12	1	1
360	Jaehoon Jung	1	11	1	2
360	Wai-Leung Yim	1	11	1	2
360	Stanko Hocevar	1	11	1	1
360	Changhoon Lee	1	11	1	1
360	Bryan M Wong	1	11	3	4
360	Eduardo Fabiano	1	11	2	3
360	David M Smith	1	11	1	3
360	Carlos L Simmerling	1	11	1	5
360	Satoshi Yabushita	2	15	1	2
360	Matej Praprotnik	1	11	2	5
360	Fabio Della Sala	1	11	2	5
360	Thorsten Klüner	1	11	1	2
360	Karmen Condic-Jurkic	1	11	1	1
360	Kun Song	1	11	1	2
375	Michael C Owen	1	10	1	1
375	Chuan-Lu Yang	1	10	3	8
375	Elena Voloshina	1	10	1	2
375	Kun Liu	1	10	1	2
375	Wensheng Bian	1	10	2	4
380	Misako Aida	1	9	2	3
380	Xin Xu	1	9	3	7
380	Chi H Mak	1	9	1	1
380	Igor Ying Zhang	1	9	1	1
380	Roberto Righini	1	9	1	3
380	Victor V Volkov	1	9	1	1
380	Riccardo Chelli	1	9	1	5
387	Xueye Wang	1	8	2	5
387	Zhong-Fang Chen	1	8	4	7
387	Jijun Zhao	1	8	5	13
387	Shuwei Tang	1	8	1	1
387	Hajime Hirao	1	8	4	10
387	Zhen Zhou	1	8	3	5
393	Ya-Jun Liu	1	7	1	3
393	Slawomir Berski	1	7	1	3
393	Mengtao Sun	1	7	3	6
393	Antonio Rey	1	7	1	2
393	David De Sancho	1	7	1	2
393	William Goddard	2	13	2	12
393	Xiang-Yuan Li	1	7	1	3
393	Frank R Wagner	1	7	2	6
393	Alexander Myshlyavtsev	1	7	1	1
393	Masahiko Hada	1	7	4	5
393	Zdzisław Xl;law Latajka	1	7	1	2
393	David R Kent Iv	2	13	1	1
405	Thenmalarchelvi Rathinavelan	1	6	1	1
405	Dmitry N Tarasov	1	6	1	1
405	Gyula Tasi	1	6	1	2
405	Thomas Bredow	1	6	1	4
409	David Zanuy	1	4	2	6
409	Assoc Prof Lin Cheng	1	4	1	3
409	Ricardo D Enriz	1	4	2	3
409	Richard H Duncan Lyngdoh	1	4	1	1
409	Fernando D Suvire	1	4	1	2
409	Sophie Barbe	1	4	1	3
409	Siamkhanthang Neihsial	1	4	1	1
416	Grzegorz Mazur	1	3	1	1
416	Laurence Leherte	1	3	1	2
416	Allan East	1	3	1	2
419	Maciej Gutowski	1	2	2	7
419	Maciej Haranczyk	1	2	3	11
419	Qi Dai	1	2	1	3
422	Jilai Li	1	1	1	2
423	Jinn-Moon Yang	1	0	1	6
423	Yi-Yuan Chiu	1	0	1	0
423	Hassan Safouhi	1	0	1	4
423	Ahmed Bouferguene	1	0	1	2

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